| Stability of aqueous silica nanoparticle dispersions CO Metin, LW Lake, CR Miranda, QP Nguyen Journal of Nanoparticle Research 13, 839-850, 2011 | 351 | 2011 |
| Effect of particle size and surface structure on adsorption of O and OH on platinum nanoparticles: A first-principles study BC Han, CR Miranda, G Ceder Physical Review B—Condensed Matter and Materials Physics 77 (7), 075410, 2008 | 230 | 2008 |
| Self-accumulation of aromatics at the oil− water interface through weak hydrogen bonding M Kunieda, K Nakaoka, Y Liang, CR Miranda, A Ueda, S Takahashi, ... Journal of the American Chemical Society 132 (51), 18281-18286, 2010 | 219 | 2010 |
| Mechanical strength and coordination defects in compressed silica glass: Molecular dynamics simulations Y Liang, CR Miranda, S Scandolo Physical Review B—Condensed Matter and Materials Physics 75 (2), 024205, 2007 | 182 | 2007 |
| Stability and mobility of functionalized silica nanoparticles for enhanced oil recovery applications CR Miranda, LS de Lara, BC Tonetto SPE international oilfield nanotechnology conference and exhibition, SPE …, 2012 | 178 | 2012 |
| Molecular dynamics studies of fluid/oil interfaces for improved oil recovery processes LS de Lara, MF Michelon, CR Miranda The Journal of Physical Chemistry B 116 (50), 14667-14676, 2012 | 153 | 2012 |
| Optimizing Active Sites for High CO Selectivity during CO2 Hydrogenation over Supported Nickel Catalysts TS Galhardo, AH Braga, BH Arpini, J Szanyi, RV Gonçalves, BF Zornio, ... Journal of the American Chemical Society 143 (11), 4268-4280, 2021 | 150 | 2021 |
| Ab initio investigation of ammonia-borane complexes for hydrogen storage CR Miranda, G Ceder The Journal of chemical physics 126 (18), 2007 | 138 | 2007 |
| Infrared and Raman spectra of silica polymorphs from an ab initio parametrized polarizable force field Y Liang, CR Miranda, S Scandolo The Journal of chemical physics 125 (19), 2006 | 88 | 2006 |
| Aggregation kinetics and shear rheology of aqueous silica suspensions CO Metin, RT Bonnecaze, LW Lake, CR Miranda, QP Nguyen Applied Nanoscience 4, 169-178, 2014 | 72 | 2014 |
| Modeling acid oil component interactions with carbonate reservoirs: a first-principles view on low salinity recovery mechanisms VM Sánchez, CR Miranda The Journal of Physical Chemistry C 118 (33), 19180-19187, 2014 | 53 | 2014 |
| First-principles investigation of transition metal dichalcogenide nanotubes for Li and Mg ion battery applications AO Pereira, CR Miranda The Journal of Physical Chemistry C 119 (8), 4302-4311, 2015 | 51 | 2015 |
| Transitions between disordered phases in supercooled liquid silicon CR Miranda, A Antonelli The Journal of chemical physics 120 (24), 11672-11677, 2004 | 51 | 2004 |
| Atomic scale insights into ethanol oxidation on Pt, Pd and Au metallic nanofilms: A DFT with van der Waals interactions AO Pereira, CR Miranda Applied surface science 288, 564-571, 2014 | 50 | 2014 |
| Molecular dynamics simulations of water confined in calcite slit pores: an NMR spin relaxation and hydrogen bond analysis SM Mutisya, A Kirch, JM De Almeida, VM Sanchez, CR Miranda The Journal of Physical Chemistry C 121 (12), 6674-6684, 2017 | 48 | 2017 |
| Hydrocarbon adsorption on carbonate mineral surfaces: a first-principles study with van der Waals interactions VA Rigo, CO Metin, QP Nguyen, CR Miranda The Journal of Physical Chemistry C 116 (46), 24538-24548, 2012 | 47 | 2012 |
| Molecular simulations of cement based materials: A comparison between first principles and classical force field calculations SM Mutisya, JM de Almeida, CR Miranda Computational Materials Science 138, 392-402, 2017 | 46 | 2017 |
| An ab initio study of lithium diffusion in titanium disulfide nanotubes K Tibbetts, CR Miranda, YS Meng, G Ceder Chemistry of Materials 19 (22), 5302-5308, 2007 | 46 | 2007 |
| Tuning oxygen packing in silica by nonhydrostatic pressure Y Liang, CR Miranda, S Scandolo Physical Review Letters 99 (21), 215504, 2007 | 42 | 2007 |
| Computational materials science meets geophysics: dislocations and slip planes of MgO CR Miranda, S Scandolo Computer Physics Communications 169 (1-3), 24-27, 2005 | 41 | 2005 |
